Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | DGKA | P23743 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | NAAA | Q02083 | 2/20 | 0.40 |
| ▸ | PAM | P19021 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21611170 | 0.91 | DGKA (0.55) | CES1CES2DGKAALDH1A1LMNA | |
| SCHEMBL9744519 | 0.86 | ALDH1A1 (0.52) | CES1CES2DGKAALDH1A1LMNA | |
| SCHEMBL1003368 | 0.84 | CES1 (0.46) | CES1CES2DGKAALDH1A1TP53 | |
| SCHEMBL11565466 | 0.84 | CES1 (0.46) | CES1CES2DGKAALDH1A1TP53 | |
| SCHEMBL11564625 | 0.84 | CA1 (0.46) | CES1CES2DGKAALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL27410812 | 0.82 | CES1 (0.44) | CES1CES2DGKAALDH1A1TP53 | |
| SCHEMBL29108605 | 0.82 | CAMK2A (0.39) | DGKALMNAKDM4EDUSP3MEN1 | |
| SCHEMBL11285973 | 0.81 | CES1 (0.48) | CES1CES2DGKAALDH1A1TP53 | |
| SCHEMBL7983666 | 0.80 | ALDH1A1 (0.44) | CES1CES2DGKAALDH1A1TP53 | |
| SCHEMBL348478 | 0.80 | CES1 (0.42) | CES1CES2DGKAALDH1A1TP53 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4945180-A | Process for the preparation of E-2-propyl-2-pentenoic acid and physiologically compatible salts thereof | DESITIN ARZNEIMITTEL GMBH (DE) | 1990-07-31 | — | — | US | claimed |
| US-4945180-A | Process for the preparation of E-2-propyl-2-pentenoic acid and physiologically compatible salts thereof | DESITIN ARZNEIMITTEL GMBH (DE) | 1990-07-31 | — | — | US | disclosed |